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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Peroxisome proliferator-activated receptor gamma' and Ligand = 'BDBM50450112'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50450112
PNG
(CHEMBL4165766)
Show SMILES Cc1ccc(Oc2ccc3nc(COc4cccc(c4)C(O)=O)n(C)c3c2)nc1
Show InChI InChI=1S/C22H19N3O4/c1-14-6-9-21(23-12-14)29-17-7-8-18-19(11-17)25(2)20(24-18)13-28-16-5-3-4-15(10-16)22(26)27/h3-12H,13H2,1-2H3,(H,26,27)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 129n/an/an/an/a



Daiichi Sankyo Co., Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at recombinant human GAL4-DBD fused PPARgamma LBD expressed in COS7 cells after 24 hrs by luciferase reporter gene assay


Bioorg Med Chem 26: 5099-5117 (2018)


Article DOI: 10.1016/j.bmc.2018.09.005
BindingDB Entry DOI: 10.7270/Q2XK8J3V
More data for this
Ligand-Target Pair